heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-N-methylcarbamate
heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-N-methylcarbamate
| Molecular Formula | C21H32N2O5S |
|---|---|
| Molecular Weight | 424.6 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 93.6 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 424.2032 |
| Heavy Atoms | 29 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 65907-32-6 |
|---|---|
| SMILES | CCCCCCCOC(=O)N(C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C |
| InChIKey | WFWZHEUYUFPXRQ-UHFFFAOYSA-N |
📖 Product Overview
heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-N-methylcarbamate (CAS: 65907-32-6) is a chemical compound with molecular formula C21H32N2O5S and molecular weight 424.6 g/mol. Its IUPAC systematic name is heptyl N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-N-methylcarbamate.
WFWZHEUYUFPXRQ-UHFFFAOYSA-N.
SMILES: CCCCCCCOC(=O)N(C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C.
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